tert-butyl 3-[(3-propan-2-ylcyclobutyl)amino]azetidine-1-carboxylate

C15H28N2O2 — CID 103578453

IUPACtert-butyl 3-[(3-propan-2-ylcyclobutyl)amino]azetidine-1-carboxylate
SMILESCC(C)C1CC(NC2CN(C(=O)OC(C)(C)C)C2)C1
InChIInChI=1S/C15H28N2O2/c1-10(2)11-6-12(7-11)16-13-8-17(9-13)14(18)19-15(3,4)5/h10-13,16H,6-9H2,1-5H3
InChIKeyUCHVTLXGRBNSKF-UHFFFAOYSA-N
MW268.40 g/mol
LogP2.63
Rot. Bonds3

About tert-butyl 3-[(3-propan-2-ylcyclobutyl)amino]azetidine-1-carboxylate

tert-butyl 3-[(3-propan-2-ylcyclobutyl)amino]azetidine-1-carboxylate (PubChem CID 103578453) has the molecular formula C15H28N2O2 and a molecular weight of 268.40 g/mol. Its IUPAC name is tert-butyl 3-[(3-propan-2-ylcyclobutyl)amino]azetidine-1-carboxylate.

Molecular Properties

Compound Nametert-butyl 3-[(3-propan-2-ylcyclobutyl)amino]azetidine-1-carboxylate
PubChem CID103578453
Molecular FormulaC15H28N2O2
Molecular Weight268.40 g/mol
Exact Mass268.22
IUPAC Nametert-butyl 3-[(3-propan-2-ylcyclobutyl)amino]azetidine-1-carboxylate
SMILESCC(C)C1CC(NC2CN(C(=O)OC(C)(C)C)C2)C1
InChIInChI=1S/C15H28N2O2/c1-10(2)11-6-12(7-11)16-13-8-17(9-13)14(18)19-15(3,4)5/h10-13,16H,6-9H2,1-5H3
InChIKeyUCHVTLXGRBNSKF-UHFFFAOYSA-N
XLogP2.63
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.40
LogP ≤ 52.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze tert-butyl 3-[(3-propan-2-ylcyclobutyl)amino]azetidine-1-carboxylate with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

tert-butyl 3-[(4-propan-2-ylcyclohexyl)amino]azetidine-1-carboxylate
CID 107241780
tert-butyl 3-[(3-propan-2-ylcyclohexyl)amino]pyrrolidine-1-carboxylate
CID 107448863
tert-butyl 3-(cyclobutylamino)azetidine-1-carboxylate
CID 53484509
tert-butyl N-[4-[(3-propan-2-ylcyclobutyl)amino]cyclohexyl]carbamate
CID 103578438
tert-butyl 3-[[(3S)-pyrrolidin-3-yl]amino]azetidine-1-carboxylate
CID 67289806
tert-butyl 3-[(3,3,5,5-tetramethylcyclohexyl)amino]azetidine-1-carboxylate
CID 103965667
tert-butyl 3-[[(4-propan-2-ylcyclohexyl)amino]methyl]azetidine-1-carboxylate
CID 58394498
tert-butyl 4-propan-2-ylpiperidine-1-carboxylate
CID 22899309
tert-butyl 5,6-dihydroxy-1,3,3a,4,5,6,7,7a-octahydroisoindole-2-carboxylate
CID 112547151
tert-butyl 3-[(3-methylcyclobutyl)amino]pyrrolidine-1-carboxylate
CID 115735709
tert-butyl 4-[2-[(3-propan-2-ylcyclobutyl)amino]ethyl]piperazine-1-carboxylate
CID 103578415
tert-butyl (3S)-3-propan-2-ylpyrrolidine-1-carboxylate
CID 139452592

Frequently Asked Questions

What is the IUPAC name of tert-butyl 3-[(3-propan-2-ylcyclobutyl)amino]azetidine-1-carboxylate?
The IUPAC name of tert-butyl 3-[(3-propan-2-ylcyclobutyl)amino]azetidine-1-carboxylate (CID 103578453) is tert-butyl 3-[(3-propan-2-ylcyclobutyl)amino]azetidine-1-carboxylate.
What is the SMILES notation for tert-butyl 3-[(3-propan-2-ylcyclobutyl)amino]azetidine-1-carboxylate?
The canonical SMILES for tert-butyl 3-[(3-propan-2-ylcyclobutyl)amino]azetidine-1-carboxylate is CC(C)C1CC(NC2CN(C(=O)OC(C)(C)C)C2)C1.
What is the InChIKey of tert-butyl 3-[(3-propan-2-ylcyclobutyl)amino]azetidine-1-carboxylate?
The InChIKey is UCHVTLXGRBNSKF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N2O2/c1-10(2)11-6-12(7-11)16-13-8-17(9-13)14(18)19-15(3,4)5/h10-13,16H,6-9H2,1-5H3.
What are the key properties of tert-butyl 3-[(3-propan-2-ylcyclobutyl)amino]azetidine-1-carboxylate?
tert-butyl 3-[(3-propan-2-ylcyclobutyl)amino]azetidine-1-carboxylate has a molecular weight of 268.40 g/mol, XLogP of 2.63, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl 3-[(3-propan-2-ylcyclobutyl)amino]azetidine-1-carboxylate is sourced from PubChem (CID 103578453), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).